3-amino-4-iodobenzonitrile

3-amino-4-iodobenzonitrile

CAS: 665033-21-6

Formula: C7H5IN2

SMILES: NC1=CC(=CC=C1I)C#N

IUPAC: 3-amino-4-iodobenzonitrile

InChI: InChI=1S/C7H5IN2/c8-6-2-1-5(4-9)3-7(6)10/h1-3H,10H2

Composition: C (34.45%), H (2.07%), I (52.00%), N (11.48%)

Molar Mass: 244.035

Atom Count: 15

Heavy Atom Count: 10

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	243.94974
Formal Charge	0
FSP3	0
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	JURDBYHADODTPF-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	49.84
Topological Polar Surface Area	49.81
Polarizability	18.5
Ring Count	1
Rotatable Bond Count	0

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Purity	LeadTime	CAS	PacketSize	UnitPrice
98%	<5 Days	665033-21-6		$112.23-$408.56$112.23$408.56